2-[4-[4-[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]butoxy]-3-methoxy-phenyl]ethanal

Systemtic Name: 2-[4-[4-[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]butoxy]-3-methoxy-phenyl]ethanal Openeye Name: 2-[4-[4-[4-(1,2-benzoxazol-3-yl)-1-piperidyl]butoxy]-3-methoxy-phenyl]acetaldehyde CAS Name: 2-[4-[4-[4-(1,2-benzoxazol-3-yl)-1-piperidinyl]butoxy]-3-methoxyphenyl]acetaldehyde IUPAC Name: 2-[4-[4-[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]butoxy]-3-methoxyphenyl]acetaldehyde Traditional Name: 2-[4-[4-(4-indoxazen-3-ylpiperidino)butoxy]-3-methoxy-phenyl]acetaldehyde Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=O)OCCCCN2CCC(CC2)C3=NOC4=CC=CC=C43

Isomeric SMILES

COC1=C(C=CC(=C1)CC=O)OCCCCN2CCC(CC2)C3=NOC4=CC=CC=C43

InChI

InChI=1S/C25H30N2O4/c1-29-24-18-19(12-16-28)8-9-23(24)30-17-5-4-13-27-14-10-20(11-15-27)25-21-6-2-3-7-22(21)31-26-25/h2-3,6-9,16,18,20H,4-5,10-15,17H2,1H3