N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxidanylidene-pentan-2-yl]-6-phenylmethoxy-naphthalene-2-carboxamide

Systemtic Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxidanylidene-pentan-2-yl]-6-phenylmethoxy-naphthalene-2-carboxamide Openeye Name: 6-benzyloxy-N-[(1S)-1-(2-dimethylaminoethylcarbamoyl)butyl]naphthalene-2-carboxamide CAS Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxopentan-2-yl]-6-phenylmethoxy-2-naphthalenecarboxamide IUPAC Name: N-[(2S)-1-(2-dimethylaminoethylamino)-1-oxopentan-2-yl]-6-phenylmethoxynaphthalene-2-carboxamide Traditional Name: 6-benzoxy-N-[(1S)-1-(2-dimethylaminoethylcarbamoyl)butyl]-2-naphthamide Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NCCN(C)C)NC(=O)C1=CC2=C(C=C1)C=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCC[C@@H](C(=O)NCCN(C)C)NC(=O)C1=CC2=C(C=C1)C=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C27H33N3O3/c1-4-8-25(27(32)28-15-16-30(2)3)29-26(31)23-12-11-22-18-24(14-13-21(22)17-23)33-19-20-9-6-5-7-10-20/h5-7,9-14,17-18,25H,4,8,15-16,19H2,1-3H3,(H,28,32)(H,29,31)/t25-/m0/s1