2-methoxyethyl 2-[2-azanyl-7-[4-[(E)-piperidin-1-yliminomethyl]phenyl]carbonyl-3,4-dihydro-2H-chromen-3-yl]ethanoate

Systemtic Name: 2-methoxyethyl 2-[2-azanyl-7-[4-[(E)-piperidin-1-yliminomethyl]phenyl]carbonyl-3,4-dihydro-2H-chromen-3-yl]ethanoate Openeye Name: 2-methoxyethyl 2-[2-amino-7-[4-[(E)-1-piperidyliminomethyl]benzoyl]chroman-3-yl]acetate CAS Name: 2-[2-amino-7-[oxo-[4-[(E)-1-piperidinyliminomethyl]phenyl]methyl]-3,4-dihydro-2H-1-benzopyran-3-yl]acetic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 2-[2-amino-7-[4-[(E)-piperidin-1-yliminomethyl]benzoyl]-3,4-dihydro-2H-chromen-3-yl]acetate Traditional Name: 2-[2-amino-7-[4-[(E)-piperidinoiminomethyl]benzoyl]chroman-3-yl]acetic acid 2-methoxyethyl ester Formula: C27H33N3O5 MolecularWeight: 479.56802

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)CC1CC2=C(C=C(C=C2)C(=O)C3=CC=C(C=C3)C=NN4CCCCC4)OC1N

Isomeric SMILES

COCCOC(=O)CC1CC2=C(C=C(C=C2)C(=O)C3=CC=C(C=C3)/C=N/N4CCCCC4)OC1N

InChI

InChI=1S/C27H33N3O5/c1-33-13-14-34-25(31)17-23-15-21-9-10-22(16-24(21)35-27(23)28)26(32)20-7-5-19(6-8-20)18-29-30-11-3-2-4-12-30/h5-10,16,18,23,27H,2-4,11-15,17,28H2,1H3/b29-18+