methyl 3-(7-isocyanonaphthalen-2-yl)-2-[4-(1-methylpyrrolidin-3-yl)oxyphenyl]propanoate

Systemtic Name: methyl 3-(7-isocyanonaphthalen-2-yl)-2-[4-(1-methylpyrrolidin-3-yl)oxyphenyl]propanoate Openeye Name: methyl 3-(7-isocyano-2-naphthyl)-2-[4-(1-methylpyrrolidin-3-yl)oxyphenyl]propanoate CAS Name: 3-(7-isocyano-2-naphthalenyl)-2-[4-[(1-methyl-3-pyrrolidinyl)oxy]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-(7-isocyanonaphthalen-2-yl)-2-[4-(1-methylpyrrolidin-3-yl)oxyphenyl]propanoate Traditional Name: 3-(7-isocyano-2-naphthyl)-2-[4-(1-methylpyrrolidin-3-yl)oxyphenyl]propionic acid methyl ester Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C1)OC2=CC=C(C=C2)C(CC3=CC4=C(C=C3)C=CC(=C4)[N+]#[C-])C(=O)OC

Isomeric SMILES

CN1CCC(C1)OC2=CC=C(C=C2)C(CC3=CC4=C(C=C3)C=CC(=C4)[N+]#[C-])C(=O)OC

InChI

InChI=1S/C26H26N2O3/c1-27-22-9-6-19-5-4-18(14-21(19)16-22)15-25(26(29)30-3)20-7-10-23(11-8-20)31-24-12-13-28(2)17-24/h4-11,14,16,24-25H,12-13,15,17H2,2-3H3